%chk=000132514.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132514

0 1
 O    1.286900       3.942800     -0.7219000    
 O   -3.346700       1.050600     -0.6093000    
 O   -3.117900       1.553600       1.615800    
 N    2.888400       1.412900     -0.3967000    
 C    1.005000      0.3533000      0.1533000    
 C  -0.3811000      0.2619000      0.3993000    
 C    1.536500       1.588500     -0.2181000    
 C    2.087100     -0.5825000      0.1939000    
 C    3.248200      0.1083000     -0.1538000    
 C   -1.030100      -1.028000      0.8009000    
 C   -1.178500       1.404100      0.2647000    
 C   0.7520000       2.739300     -0.3567000    
 C  -0.6181000       2.623600     -0.1077000    
 C    2.184900      -1.957200      0.4954000    
 C    4.504500     -0.5056000     -0.2156000    
 C   -1.498900      -1.835700     -0.3811000    
 C    3.434300      -2.585000      0.4378000    
 C    4.575700      -1.867800      8.7399997E-02
 C   -2.614600       1.350400      0.5112000    
 C   -2.554600      -2.669000     -0.4500000    
 C   -2.967800      -3.447300      -1.666700    
 C   -3.428300      -2.892500      0.7559000    
 C   -4.766800      0.9814000     -0.4377000    
 H    3.530600       2.143900     -0.6696000    
 H  -0.3476000      -1.624200       1.409000    
 H   -1.854200     -0.8164000       1.489500    
 H   -1.255700       3.500400     -0.2067000    
 H    1.326200      -2.564600      0.7545000    
 H    5.394000      5.2400000E-02 -0.4889000    
 H  -0.8921000      -1.742600      -1.281900    
 H    3.512900      -3.644900      0.6649000    
 H    5.536600      -2.374400      4.7300000E-02
 H   0.5736000       4.603000     -0.7587000    
 H   -2.313100      -3.239000      -2.519400    
 H   -2.925000      -4.522700      -1.466900    
 H   -3.989800      -3.184300      -1.957900    
 H   -2.982600      -2.570700       1.699600    
 H   -4.383100      -2.372500      0.6286000    
 H   -3.637800      -3.962200      0.8714000    
 H   -5.023000      0.2195000      0.3044000    
 H   -5.211200      0.7008000      -1.396300    
 H   -5.157600       1.959000     -0.1403000    


%chk=000132514-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000132514

0 1
O 1.151233 3.739721 -1.181367
O -3.473495 2.407076 -0.015244
O -3.521046 0.329531 1.003265
N 2.730432 1.381416 -0.611934
C 0.843914 0.241265 0.092766
C -0.543985 0.102743 0.394779
C 1.356805 1.476034 -0.422429
C 2.007089 -0.652798 0.206672
C 3.157155 0.097595 -0.235115
C -1.053551 -1.235564 0.924438
C -1.381622 1.237370 0.143513
C 0.523196 2.585345 -0.669710
C -0.837579 2.456957 -0.388753
C 2.204138 -1.995943 0.620166
C 4.459483 -0.441383 -0.256926
C -1.204256 -2.261647 -0.195041
C 3.504582 -2.542777 0.604334
C 4.621017 -1.775016 0.173189
C -2.843086 1.224812 0.432510
C -2.283039 -3.060575 -0.440020
C -2.255728 -4.053917 -1.592991
C -3.566461 -3.063369 0.372969
C -4.926567 2.478300 0.245187
H 3.312016 2.137847 -0.965895
H -0.322565 -1.606655 1.670995
H -2.007777 -1.098674 1.447522
H -1.524312 3.290432 -0.564533
H 1.364487 -2.618133 0.938830
H 5.316727 0.150135 -0.596060
H -0.337938 -2.352268 -0.867766
H 3.656561 -3.579079 0.924525
H 5.619362 -2.226344 0.169854
H 0.494873 4.464848 -1.322562
H -1.286368 -4.046696 -2.121279
H -2.445012 -5.085335 -1.233236
H -3.052452 -3.825761 -2.329250
H -3.667531 -2.176759 1.017605
H -4.445363 -3.090431 -0.300614
H -3.626640 -3.971034 1.007381
H -5.449595 1.649433 -0.261203
H -5.237095 3.450628 -0.163819
H -5.128805 2.419269 1.328145


